CAS 898765-43-0

1-(4-Chlorophenyl)-2,2-dimethyl-1-butanone

Description:

1-(4-Chlorophenyl)-2,2-dimethyl-1-butanone, identified by its CAS number 898765-43-0, is an organic compound characterized by its ketone functional group and a substituted aromatic ring. This compound features a 4-chlorophenyl group, which contributes to its chemical properties and potential reactivity. The presence of the dimethyl groups on the butanone backbone enhances its steric hindrance, influencing its physical and chemical behavior. Typically, such compounds exhibit moderate to low solubility in water due to their hydrophobic characteristics, while being more soluble in organic solvents. The chlorophenyl moiety may impart specific biological activities, making it of interest in pharmaceutical and agrochemical research. Additionally, the compound's structure suggests potential applications in organic synthesis and material science. Safety and handling precautions are essential, as with many organic compounds, due to potential toxicity and environmental impact. Overall, 1-(4-Chlorophenyl)-2,2-dimethyl-1-butanone is a notable compound in the realm of organic chemistry, with various implications in research and industry.

Formula: C₁₂H₁₅ClO

InChI: InChI=1S/C12H15ClO/c1-4-12(2,3)11(14)9-5-7-10(13)8-6-9/h5-8H,4H2,1-3H3

InChI key: InChIKey=CGUCYSUNSHBABN-UHFFFAOYSA-N

SMILES: C(C(CC)(C)C)(=O)C1=CC=C(Cl)C=C1

Synonyms:

• 1-Butanone, 1-(4-chlorophenyl)-2,2-dimethyl-
• 1-(4-Chlorophenyl)-2,2-dimethyl-1-butanone